SCHEMBL9826905

SCHEMBL9826905

NOc1ccc2ccccc2n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NCF1 P14598 3/20 0.52
▸ NOS2 P35228 1/20 0.52
▸ BACE1 P56817 1/20 0.52
▸ MAPT P10636 5/20 0.47
▸ MEN1 O00255 4/20 0.47
▸ KMT2A Q03164 4/20 0.47
▸ CYP1A2 P05177 2/20 0.46
▸ CA12 O43570 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ NPC1 O15118 4/20 0.42
▸ RAB9A P51151 4/20 0.42
▸ ALDH1A1 P00352 6/20 0.42
▸ HPGD P15428 2/20 0.42
▸ GLA P06280 1/20 0.42
▸ ACHE P22303 1/20 0.42
▸ CYP3A4 P08684 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ TP53 P04637 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31498821 0.81 NCF1 (0.50) NCF1NOS2BACE1MAPTMEN1
SCHEMBL1131286 0.81 NCF1 (0.50) NCF1NOS2BACE1MAPTMEN1
Phosphine SCHEMBL23753735 0.79 MAPT (0.49) NCF1NOS2BACE1MAPTMEN1
SCHEMBL5593982 0.77 MAPT (0.47) NCF1NOS2BACE1MAPTMEN1
SCHEMBL17440166 0.77 MAPT (0.47) NCF1NOS2BACE1MAPTMEN1
SCHEMBL6750168 0.77 MAPT (0.47) NCF1NOS2BACE1MAPTMEN1
SCHEMBL4458474 0.77 MAPT (0.47) NCF1NOS2BACE1MAPTMEN1
SCHEMBL7942319 0.77 MAPT (0.47) NCF1NOS2BACE1MAPTMEN1
SCHEMBL6026855 0.77 MAPT (0.47) NCF1NOS2BACE1MAPTMEN1
SCHEMBL29392943 0.77 KDM4E (0.53) NCF1NOS2BACE1MAPTMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0433451-A1 OXIME DERIVATIVES AND HERBICIDES CONTAINING THE SAME AS AN ACTIVE INGREDIENT TEIJIN LIMITED (JP) 1991-06-26 — — EP disclosed
WO-1990001874-A1 OXIME DERIVATIVES AND HERBICIDES CONTAINING THE SAME AS AN ACTIVE INGREDIENT TEIJIN LIMITED (JP) 1990-03-08 — — WO disclosed
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